SCHEMBL6337803

SCHEMBL6337803

O=C(NC1CCNCC1)c1cc(=O)c2cc(Cl)ccc2o1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 8/20 0.59
▸ ALDH1A1 P00352 2/20 0.55
▸ ACHE P22303 3/20 0.53
▸ MAOB P27338 4/20 0.51
▸ KCNH2 Q12809 4/20 0.49
▸ MAOA P21397 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ NR1I2 O75469 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ AHR P35869 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MCHR2 Q969V1 1/20 0.45
▸ MAPT P10636 2/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6337794 0.91 MCHR1 (0.59) MCHR1ACHEMAOBKCNH2MCHR2
SCHEMBL6338073 0.86 MCHR1 (0.59) MCHR1ACHEKCNH2NPC1RAB9A
SCHEMBL6332263 0.86 MCHR1 (0.57) MCHR1ACHEMAOBKCNH2
SCHEMBL30578688 0.84 RAB9A (0.57) ALDH1A1KDM4ENPC1NR1I2HPGD
SCHEMBL21062361 0.84 RAB9A (0.57) ALDH1A1KDM4ENPC1NR1I2HPGD
Hydrochloric Acid SCHEMBL21050122 0.83 RAB9A (0.56) ALDH1A1KDM4ENPC1NR1I2HPGD
SCHEMBL6329928 0.82 MCHR1 (0.55) MCHR1ACHEMAOBKCNH2MCHR2
SCHEMBL6333533 0.82 MCHR1 (0.60) MCHR1ACHEMAOBKCNH2MCHR2
SCHEMBL6331471 0.81 MCHR1 (0.56) MCHR1ACHEMAOBKCNH2MCHR2
SCHEMBL6329320 0.79 MCHR1 (0.67) MCHR1KCNH2MCHR2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050209274-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABOTT LABORATORIES 2005-09-22 — — US disclosed
US-20050187387-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor ABBOTT LABORATORIES 2005-08-25 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050209274-A1 Antagonists of melanin concentrating hormone effects on the melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885ALDH1A1 1308/4885ACHE 1595/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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